Chemical Properties of Sarcosine, n-pentafluoropropionyl-, dodecyl ester

InChI

InChI=1S/C18H30F5NO3/c1-3-4-5-6-7-8-9-10-11-12-13-27-15(25)14-24(2)16(26)17(19,20)18(21,22)23/h3-14H2,1-2H3

InChI Key

WWXGTSBKIFCNNS-UHFFFAOYSA-N

Formula

C18H30F5NO3

SMILES

CCCCCCCCCCCCOC(=O)CN(C)C(=O)C(F)(F)C(F)(F)F

Molecular Weight¹

403.43

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-1119.75	kJ/mol	Joback Calculated Property
ΔfH°gas	-1702.75	kJ/mol	Joback Calculated Property
ΔfusH°	50.35	kJ/mol	Joback Calculated Property
ΔvapH°	66.93	kJ/mol	Joback Calculated Property
log10WS	-5.54		Crippen Calculated Property
logPoct/wat	5.106		Crippen Calculated Property
McVol	292.320	ml/mol	McGowan Calculated Property
Pc	1092.10	kPa	Joback Calculated Property
Inp	[2038.00; 2038.00]
Inp	2038.00		NIST
Inp	2038.00		NIST
Tboil	743.73	K	Joback Calculated Property
Tc	913.21	K	Joback Calculated Property
Tfus	454.97	K	Joback Calculated Property
Vc	1.159	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[902.21; 987.18]	J/mol×K	[743.73; 913.21]
Cp,gas	902.21	J/mol×K	743.73	Joback Calculated Property
Cp,gas	918.45	J/mol×K	771.98	Joback Calculated Property
Cp,gas	933.80	J/mol×K	800.22	Joback Calculated Property
Cp,gas	948.30	J/mol×K	828.47	Joback Calculated Property
Cp,gas	962.00	J/mol×K	856.72	Joback Calculated Property
Cp,gas	974.94	J/mol×K	884.96	Joback Calculated Property
Cp,gas	987.18	J/mol×K	913.21	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, n-pentafluoropropionyl-, dodecyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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